3,4-bis(ethenyl)-7-pyrrolo[3,2-b]pyridin-1-ylquinoline

C20H15N3 — CID 167513406

IUPAC3,4-bis(ethenyl)-7-pyrrolo[3,2-b]pyridin-1-ylquinoline
SMILESC=Cc1cnc2cc(-n3ccc4ncccc43)ccc2c1C=C
InChIInChI=1S/C20H15N3/c1-3-14-13-22-19-12-15(7-8-17(19)16(14)4-2)23-11-9-18-20(23)6-5-10-21-18/h3-13H,1-2H2
InChIKeyNFYCXQGVUHECGG-UHFFFAOYSA-N
MW297.36 g/mol
LogP4.86
Rot. Bonds3

About 3,4-bis(ethenyl)-7-pyrrolo[3,2-b]pyridin-1-ylquinoline

3,4-bis(ethenyl)-7-pyrrolo[3,2-b]pyridin-1-ylquinoline (PubChem CID 167513406) has the molecular formula C20H15N3 and a molecular weight of 297.36 g/mol. Its IUPAC name is 3,4-bis(ethenyl)-7-pyrrolo[3,2-b]pyridin-1-ylquinoline.

Molecular Properties

Compound Name3,4-bis(ethenyl)-7-pyrrolo[3,2-b]pyridin-1-ylquinoline
PubChem CID167513406
Molecular FormulaC20H15N3
Molecular Weight297.36 g/mol
Exact Mass297.13
IUPAC Name3,4-bis(ethenyl)-7-pyrrolo[3,2-b]pyridin-1-ylquinoline
SMILESC=Cc1cnc2cc(-n3ccc4ncccc43)ccc2c1C=C
InChIInChI=1S/C20H15N3/c1-3-14-13-22-19-12-15(7-8-17(19)16(14)4-2)23-11-9-18-20(23)6-5-10-21-18/h3-13H,1-2H2
InChIKeyNFYCXQGVUHECGG-UHFFFAOYSA-N
XLogP4.86
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 54.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-hydroxypyrrolo[3,2-b]pyridine
CID 22988006
1-(5-phenyl-1H-imidazol-2-yl)pyrrolo[3,2-b]pyridine
CID 91437172
1-phenylpyrrolo[3,2-b]pyridine;1H-pyrrolo[3,2-b]pyridine
CID 160719187
1-iodopyrrolo[3,2-b]pyridine
CID 70894838
pyrrolo[3,2-b]pyridin-1-amine
CID 19601545
6-ethenyl-5-ethylquinoline
CID 166703553
N-methyl-1-quinolin-6-ylimidazol-2-amine
CID 106570148
5-[3,5-bis(ethenyl)phenyl]-8-(8-pyrido[3,2-b]indol-5-ylpyrido[3,2-b]indol-5-yl)pyrido[3,2-b]indole
CID 134274167
6-(2,6-dipyridin-2-yl-4-pyridinyl)-3-(2-pyridin-4-ylpyrimidin-5-yl)pyrrolo[2,3-c]carbazole
CID 123202086
osmium;bis(2-pyridin-2-ylpyridine);3,4,5-tris(ethenyl)-2-pyridin-2-ylpyridine;dihydrochloride
CID 173320547
4-[(1-quinolin-6-ylindol-5-yl)methyl]morpholine
CID 156772741
[7,8-bis(ethenyl)-4-methanimidoyl-1,10-phenanthrolin-3-yl]methanimine
CID 163973866

Frequently Asked Questions

What is the IUPAC name of 3,4-bis(ethenyl)-7-pyrrolo[3,2-b]pyridin-1-ylquinoline?
The IUPAC name of 3,4-bis(ethenyl)-7-pyrrolo[3,2-b]pyridin-1-ylquinoline (CID 167513406) is 3,4-bis(ethenyl)-7-pyrrolo[3,2-b]pyridin-1-ylquinoline.
What is the SMILES notation for 3,4-bis(ethenyl)-7-pyrrolo[3,2-b]pyridin-1-ylquinoline?
The canonical SMILES for 3,4-bis(ethenyl)-7-pyrrolo[3,2-b]pyridin-1-ylquinoline is C=Cc1cnc2cc(-n3ccc4ncccc43)ccc2c1C=C.
What is the InChIKey of 3,4-bis(ethenyl)-7-pyrrolo[3,2-b]pyridin-1-ylquinoline?
The InChIKey is NFYCXQGVUHECGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N3/c1-3-14-13-22-19-12-15(7-8-17(19)16(14)4-2)23-11-9-18-20(23)6-5-10-21-18/h3-13H,1-2H2.
What are the key properties of 3,4-bis(ethenyl)-7-pyrrolo[3,2-b]pyridin-1-ylquinoline?
3,4-bis(ethenyl)-7-pyrrolo[3,2-b]pyridin-1-ylquinoline has a molecular weight of 297.36 g/mol, XLogP of 4.86, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-bis(ethenyl)-7-pyrrolo[3,2-b]pyridin-1-ylquinoline is sourced from PubChem (CID 167513406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).